orbital_charges     :real:2:4,6
  0.126301818544251E+001  0.841658123304208E+000  0.124187259651924E+001
  0.937997307540193E+000  0.126449166168232E+001  0.829558007649045E+000
  0.125005549309897E+001  0.935018924747959E+000  0.859027066618644E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
  0.857395995325311E+000  0.000000000000000E+000  0.000000000000000E+000
  0.000000000000000E+000  0.858186243912982E+000  0.000000000000000E+000
  0.000000000000000E+000  0.000000000000000E+000  0.861720394158445E+000
  0.000000000000000E+000  0.000000000000000E+000  0.000000000000000E+000
forces              :real:2:3,6
 -0.237098113098439E+000  0.135847471924217E-001  0.543811021447600E-002
  0.244729954388895E+000 -0.109502473323476E-001  0.225040982464597E-002
  0.519524968090754E-002 -0.126197878490233E-001  0.155292588298327E-001
 -0.317287300537362E-003  0.311414266745046E-002 -0.204416635632210E-001
 -0.601858316052197E-002 -0.796120166404430E-002 -0.189427534672917E-001
 -0.649122051030409E-002  0.148323469855430E-001  0.161666381615581E-001
total_energy        :real:0:
 -0.463915701506048E+001
end_coords          :real:2:3,6
 -0.128243929851943E+001  0.120076212875887E-001 -0.702458582077099E-001
  0.120136687886973E+001 -0.352212798929305E-002 -0.772159235439844E-001
 -0.240923297894842E+001  0.179495536097774E+001 -0.167165916840087E+000
 -0.237889354158535E+001 -0.174027285137498E+001 -0.209048254075640E+000
  0.239190105468801E+001  0.171296289043598E+001 -0.229930992365849E+000
  0.230880286767582E+001 -0.181206807702347E+001 -0.956482352475437E-001
